* LIGAND DATABASE FILE (OPLS2005)
*
001      76    76    135    205     399
    1     0 S   NP   _N1_     1    28.79405    93.11025   -23.02713
    2     1 S   H    _HN1     2     1.02780    99.77286   -78.10135
    3     1 S   H    _H1_     3     1.03077    93.12395    30.52100
    4     1 S   H    _H2_     4     1.02804    20.11402   165.61118
    5     1 S   CT   _CA1     5     1.50231   130.54713   151.24643
    6     5 S   HC   _HA1     6     1.09577   105.21280    66.92667
    7     5 S   CO3  _C1_     7     1.53742   112.55458   -53.08015
    8     7 S   O2Z  _O11     8     1.26306   115.12457   -42.44975
    9     7 S   O2Z  _O12     9     1.26259   114.89341   136.68847
   10     5 S   CT   _CB1    10     1.52977   107.20495  -175.37170
   11    10 S   HC   HB11    11     1.09817   109.04936   -52.24164
   12    10 S   HC   HB12    12     1.09678   110.28802    64.07137
   13    10 S   CT   _CG1    13     1.52980   113.39354  -173.98673
   14    13 S   HC   HG11    14     1.09574   110.26258   -63.51539
   15    13 S   HC   HG12    15     1.09606   110.37359    55.92126
   16    13 S   C    _CD1    16     1.51819   111.56910   175.71097
   17    16 S   O    _OE1    17     1.22747   122.90327   -17.61585
   18    16 S   N    _N2_    18     1.38535   112.16357   163.70313
   19    18 S   H    _HN2    19     1.01554   119.18639     2.13332
   20    18 S   CT1  _CA2    20     1.46241   123.13492   179.70525
   21    20 S   HC   _HA2    21     1.09632   109.28694    -1.09110
   22    20 S   C    _C2_    22     1.53487   108.50274  -116.28822
   23    22 S   O    _O2_    23     1.23060   122.42252  -146.74045
   24    20 S   CT   _CB2    32     1.53430   111.75658   121.25452
   25    24 S   HC   HB21    33     1.09672   109.51537    60.30823
   26    24 S   HC   HB22    34     1.09556   110.99463   177.30928
   27    22 S   N    _N3_    24     1.38401   113.63478    40.58958
   28    27 S   H    _HN3    25     1.01609   119.52882    -3.27626
   29    24 S   S    _SG2    35     1.82897   114.06576   -58.92893
   30    27 S   CT   _CA3    26     1.45273   123.03057   176.95535
   31    30 S   HC   HA31    27     1.09557   107.47265   -64.44524
   32    30 S   HC   HA32    28     1.09562   107.98078    51.92580
   33    29 S   CMA  _C19    36     1.80971   101.07636   -66.84731
   34    33 S   OM   _O36    37     1.26512   120.77129   -56.65486
   35    30 S   CO3  _C3_    29     1.52909   114.24883   173.91920
   36    35 S   O2Z  _O31    30     1.26347   116.12607    -2.17502
   37    35 S   O2Z  _O32    31     1.26447   114.38325   177.92105
   38    33 S   CM   _C18    38     1.35656   110.28686   125.06199
   39    38 S   HC   _H17    39     1.08808   121.37543     0.57267
   40    38 S   CO4  _C17    40     1.50044   125.06163   179.37317
   41    40 S   O    _O37    41     1.22815   123.12264    21.29446
   42    40 S   CT   _C16    42     1.51221   115.91338  -159.95631
   43    42 S   HC   _H15    43     1.09551   108.27636   156.07746
   44    42 S   HC   _H16    44     1.09522   108.67593    39.62898
   45    42 S   CO4  _C15    45     1.51127   114.37774   -82.70238
   46    45 S   O    _O35    46     1.23099   122.46370    -5.62337
   47    45 S   CT   _C14    47     1.51970   116.94936   174.06948
   48    47 S   HC   _H13    48     1.09731   105.50576   120.75175
   49    47 S   HC   _H14    49     1.09621   108.86518     6.38414
   50    47 S   CT   _C13    50     1.54610   113.00339  -117.74653
   51    50 S   CM   _C8_    51     1.51829   109.32519   177.03912
   52    50 S   OH   _O38    75     1.43477   109.09015   -64.94328
   53    52 S   HO   _H18    76     0.97423   107.72671    49.50961
   54    51 S   CMA  _C9_    52     1.35586   126.28046  -108.00300
   55    54 S   OM   _O40    53     1.26369   131.03893  -179.04264
   56    51 S   CO4  _C7_    64     1.49900   116.71002    72.94839
   57    56 S   O    _O34    65     1.22926   120.11140   -82.39594
   58    54 S   CT   _C10    54     1.52972   118.77276     0.64407
   59    58 S   HC   _H9_    55     1.10081   111.01912   134.61646
   60    58 S   HC   _H10    56     1.10111   108.96740  -109.65589
   61    56 S   CT   _C6_    66     1.51321   116.75899    93.48912
   62    61 S   HC   _H7_    67     1.09527   109.83615    20.52249
   63    61 S   HC   _H8_    68     1.09551   107.17540   -97.12622
   64    58 S   CT   _C11    57     1.53250   115.15120    12.75625
   65    64 S   HC   _H3_    58     1.09549   110.27514    79.14899
   66    61 S   CO4  _C5_    69     1.51330   115.43536   142.12667
   67    66 S   O    _O33    70     1.22956   123.25626    -7.84658
   68    50 S   CT   _C12    59     1.53742   112.89801    53.89309
   69    68 S   HC   _H11    60     1.09620   111.83892   -48.84666
   70    68 S   HC   _H12    61     1.09961   109.94432  -163.24055
   71    64 S   OH   _O39    62     1.42458   109.87839  -162.69219
   72    71 S   HO   _H19    63     0.97241   107.47797   -56.07360
   73    66 S   CT   _C4_    71     1.50715   115.98330   173.20638
   74    73 S   HC   _H4_    72     1.09276   109.56708    60.82646
   75    73 S   HC   _H5_    73     1.09279   109.60160   -60.24044
   76    73 S   HC   _H6_    74     1.09356   109.74275  -179.64834
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   5   5   4   3
   6   3   2   1   1   7   3   7   4   8   4   3   8   4  12   5
   4  15  17   7   1  11   5   9   4   9   5   4   8   4   3   6
   5   5   4   4   2   1   1   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42  
   38    39    40  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45  
   40    41    42  
   41    42    43    44    45    46    47  
   42    43    44    45  
   43    44    45    46    47    48    49    50  
   44    45    46    47  
   45    46    47  
   46    47    48    49    50    51    68    52  
   47    48    49    50  
   48    49    50    51    54    64    68    69    70    56    52    53  
   49    50    51    68    52  
   50    51    68    52  
   51    54    55    58    64    65    68    69    70    71    56    57    61    52    53  
   54    55    58    59    60    64    68    69    70    56    57    61    62    63    66    52    53  
   53    54    56    64    68    69    70  
   68  
   55    58    59    60    64    65    68    71    56    57    61  
   58    59    60    64    56  
   57    61    62    63    66    67    73    58    68  
   61    62    63    66  
   59    60    64    65    68    69    70    71    72  
   60    64    65    68    71  
   64    65    68    71  
   62    63    66    67    73    74    75    76  
   63    66    67    73  
   66    67    73  
   65    68    69    70    71    72  
   68    69    70    71    72  
   67    73    74    75    76  
   73    74    75    76  
   69    70    71    72  
   70    71  
   71  
   72  
    0  
   74    75    76  
   75    76  
   76  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.575000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5500   0.0760   0.382600   2.0020   1.7750   0.023028004  -0.852763146
   34   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   42   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   51   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   52   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   54   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   55   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   56   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   63   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   64   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   67   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   68   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   73   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   240.000  1.763
   33    34   745.000  1.250
   33    38   465.000  1.376
   38    39   340.000  1.080
   38    40   320.000  1.462
   40    41   570.000  1.229
   40    42   317.000  1.522
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   317.000  1.522
   45    46   570.000  1.229
   45    47   317.000  1.522
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   268.000  1.529
   50    51   317.000  1.510
   50    68   268.000  1.529
   50    52   320.000  1.410
   51    54   465.000  1.376
   51    56   320.000  1.462
   54    55   745.000  1.250
   54    58   270.000  1.512
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    64   268.000  1.529
   64    65   340.000  1.090
   64    68   268.000  1.529
   64    71   320.000  1.410
   68    69   340.000  1.090
   68    70   340.000  1.090
   71    72   553.000  0.945
   56    57   570.000  1.229
   56    61   317.000  1.522
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    66   317.000  1.522
   66    67   570.000  1.229
   66    73   317.000  1.522
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   52    53   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    95.00000  113.88000
   29    33    38    65.00000  122.11800
   33    38    39    40.00000  120.50800
   33    38    40    60.00000  125.92000
   38    33    34    65.00000  137.10300
   38    40    41    80.00000  123.72100
   38    40    42    65.00000  118.62400
   40    38    39    40.00000  117.72500
   40    42    43    35.00000  109.50000
   40    42    44    35.00000  109.50000
   40    42    45    75.00000  107.99600
   42    40    41    80.00000  120.40000
   42    45    46    80.00000  120.40000
   42    45    47    70.00000  116.00000
   44    42    43    33.00000  107.80000
   45    42    43    35.00000  109.50000
   45    42    44    35.00000  109.50000
   45    47    48    35.00000  109.50000
   45    47    49    35.00000  109.50000
   45    47    50    63.00000  111.10000
   47    45    46    80.00000  120.40000
   47    50    51    70.00000  112.02700
   47    50    68    58.35000  112.70000
   47    50    52    50.00000  109.50000
   49    47    48    33.00000  107.80000
   50    47    48    37.50000  110.70000
   50    47    49    37.50000  110.70000
   50    51    54    70.00000  124.00000
   50    51    56    65.00000  116.34900
   50    68    64    58.35000  112.70000
   50    68    69    37.50000  110.70000
   50    68    70    37.50000  110.70000
   50    52    53    55.00000  108.50000
   51    54    55    65.00000  137.10300
   51    54    58    65.00000  122.18000
   51    56    57    80.00000  123.72100
   51    56    61    65.00000  118.62400
   54    58    59    45.00000  110.52000
   54    58    60    45.00000  110.52000
   54    58    64    70.00000  112.02700
   58    54    55    85.00000  112.85300
   58    64    65    37.50000  110.70000
   58    64    68    58.35000  112.70000
   58    64    71    50.00000  109.50000
   60    58    59    33.00000  107.80000
   64    58    59    37.50000  110.70000
   64    58    60    37.50000  110.70000
   64    68    69    37.50000  110.70000
   64    68    70    37.50000  110.70000
   64    71    72    55.00000  108.50000
   68    50    51    70.00000  112.02700
   68    64    65    37.50000  110.70000
   70    68    69    33.00000  107.80000
   71    64    65    35.00000  109.50000
   71    64    68    50.00000  109.50000
   56    51    54    60.00000  125.92000
   56    61    62    35.00000  109.50000
   56    61    63    35.00000  109.50000
   56    61    66    75.00000  107.99600
   61    56    57    80.00000  120.40000
   61    66    67    80.00000  120.40000
   61    66    73    70.00000  116.00000
   63    61    62    33.00000  107.80000
   66    61    62    35.00000  109.50000
   66    61    63    35.00000  109.50000
   66    73    74    35.00000  109.50000
   66    73    75    35.00000  109.50000
   66    73    76    35.00000  109.50000
   73    66    67    80.00000  120.40000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   52    50    51    90.00000  110.39200
   52    50    68    50.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.00000  1.0 1.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   1.00000 -1.0 2.0
   24    29    33    38   1.00000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    38    39   7.00000 -1.0 2.0
   29    33    38    40   7.00000 -1.0 2.0
   33    38    40    41   1.00000 -1.0 2.0
   33    38    40    42  -0.33500  1.0 1.0
   33    38    40    42   1.06600 -1.0 2.0
   33    38    40    42  -0.14000  1.0 3.0
   34    33    38    39   7.00000 -1.0 2.0
   34    33    38    40   7.00000 -1.0 2.0
   38    40    42    43   0.00000  1.0 1.0
   38    40    42    44   0.00000  1.0 1.0
   38    40    42    45   0.65300  1.0 1.0
   38    40    42    45  -0.03850 -1.0 2.0
   38    40    42    45   0.33900  1.0 3.0
   39    38    40    41   0.00000  1.0 1.0
   39    38    40    42   0.04550  1.0 1.0
   39    38    40    42   0.83000 -1.0 2.0
   39    38    40    42  -0.04000  1.0 3.0
   40    42    45    46   0.30150 -1.0 2.0
   40    42    45    47   0.65300  1.0 1.0
   40    42    45    47  -0.03850 -1.0 2.0
   40    42    45    47   0.33900  1.0 3.0
   41    40    42    43   0.00000  1.0 1.0
   41    40    42    44   0.00000  1.0 1.0
   41    40    42    45   0.30150 -1.0 2.0
   42    45    47    48   0.00000  1.0 1.0
   42    45    47    49   0.00000  1.0 1.0
   42    45    47    50   0.60050  1.0 1.0
   42    45    47    50   0.05600 -1.0 2.0
   42    45    47    50   0.26150  1.0 3.0
   43    42    45    46   0.00000  1.0 1.0
   43    42    45    47   0.00000  1.0 1.0
   44    42    45    46   0.00000  1.0 1.0
   44    42    45    47   0.00000  1.0 1.0
   45    47    50    51  -0.98800  1.0 1.0
   45    47    50    51   0.48800 -1.0 2.0
   45    47    50    51   0.76800  1.0 3.0
   45    47    50    68  -0.95700  1.0 1.0
   45    47    50    68  -0.18200 -1.0 2.0
   45    47    50    68   0.29450  1.0 3.0
   45    47    50    52  -0.09450  1.0 1.0
   45    47    50    52  -1.12950 -1.0 2.0
   45    47    50    52   0.54000  1.0 3.0
   46    45    47    48   0.00000  1.0 1.0
   46    45    47    49   0.00000  1.0 1.0
   46    45    47    50   0.30150 -1.0 2.0
   47    50    51    54   0.09850  1.0 1.0
   47    50    51    54   0.15250 -1.0 2.0
   47    50    51    54  -0.50650  1.0 3.0
   47    50    51    56   0.09700  1.0 1.0
   47    50    51    56   0.15600 -1.0 2.0
   47    50    51    56  -0.50800  1.0 3.0
   47    50    68    64   0.56750  1.0 1.0
   47    50    68    64  -0.07550 -1.0 2.0
   47    50    68    64   0.20000  1.0 3.0
   47    50    68    69   0.15000  1.0 3.0
   47    50    68    70   0.15000  1.0 3.0
   47    50    52    53  -0.11600  1.0 1.0
   47    50    52    53  -0.09450 -1.0 2.0
   47    50    52    53   0.21250  1.0 3.0
   48    47    50    51   0.15000  1.0 3.0
   48    47    50    68   0.15000  1.0 3.0
   48    47    50    52   0.23400  1.0 3.0
   49    47    50    51   0.15000  1.0 3.0
   49    47    50    68   0.15000  1.0 3.0
   49    47    50    52   0.23400  1.0 3.0
   50    51    54    55   7.00000 -1.0 2.0
   50    51    54    58   7.00000 -1.0 2.0
   50    51    56    57  -0.64400  1.0 1.0
   50    51    56    57   0.26850 -1.0 2.0
   50    51    56    61   0.25700  1.0 1.0
   50    51    56    61   0.66200 -1.0 2.0
   50    51    56    61   0.04450  1.0 3.0
   51    50    68    64   0.34400  1.0 1.0
   51    50    68    64   0.09450 -1.0 2.0
   51    50    68    64   0.11100  1.0 3.0
   51    50    68    69   0.15000  1.0 3.0
   51    50    68    70   0.15000  1.0 3.0
   51    50    52    53  -0.07800  1.0 1.0
   51    50    52    53  -0.21500 -1.0 2.0
   51    50    52    53  -0.03150  1.0 3.0
   51    54    58    59   0.00000  1.0 1.0
   51    54    58    60   0.00000  1.0 1.0
   51    54   -58    64   0.09850  1.0 1.0
   51    54   -58    64   0.15250 -1.0 2.0
   51    54   -58    64  -0.50650  1.0 3.0
   51    56    61    62   0.00000  1.0 1.0
   51    56    61    63   0.00000  1.0 1.0
   51    56    61    66   0.65300  1.0 1.0
   51    56    61    66  -0.03850 -1.0 2.0
   51    56    61    66   0.33900  1.0 3.0
   54    51    56    57   1.00000 -1.0 2.0
   54    51    56    61  -0.33500  1.0 1.0
   54    51    56    61   1.06600 -1.0 2.0
   54    51    56    61  -0.14000  1.0 3.0
   54    58    64    65   0.15000  1.0 3.0
   54    58    64    68   0.34400  1.0 1.0
   54    58    64    68   0.09450 -1.0 2.0
   54    58    64    68   0.11100  1.0 3.0
   54    58    64    71   1.05650  1.0 1.0
   54    58    64    71   0.15600 -1.0 2.0
   54    58    64    71   0.53150  1.0 3.0
   55    54    58    59   0.00000  1.0 1.0
   55    54    58    60   0.00000  1.0 1.0
   55    54    58    64   0.09700  1.0 1.0
   55    54    58    64   0.15600 -1.0 2.0
   55    54    58    64  -0.50800  1.0 3.0
   58    64   -68    50   0.56750  1.0 1.0
   58    64   -68    50  -0.07550 -1.0 2.0
   58    64   -68    50   0.20000  1.0 3.0
   58    64    68    69   0.15000  1.0 3.0
   58    64    68    70   0.15000  1.0 3.0
   58    64    71    72  -0.11600  1.0 1.0
   58    64    71    72  -0.09450 -1.0 2.0
   58    64    71    72   0.21250  1.0 3.0
   59    58    64    65   0.15000  1.0 3.0
   59    58    64    68   0.15000  1.0 3.0
   59    58    64    71   0.23400  1.0 3.0
   60    58    64    65   0.15000  1.0 3.0
   60    58    64    68   0.15000  1.0 3.0
   60    58    64    71   0.23400  1.0 3.0
   65    64    68    50   0.15000  1.0 3.0
   65    64    68    69   0.15000  1.0 3.0
   65    64    68    70   0.15000  1.0 3.0
   65    64    71    72   0.19450  1.0 3.0
   68    50   -51    54   0.09850  1.0 1.0
   68    50   -51    54   0.15250 -1.0 2.0
   68    50   -51    54  -0.50650  1.0 3.0
   68    50    51    56   0.09700  1.0 1.0
   68    50    51    56   0.15600 -1.0 2.0
   68    50    51    56  -0.50800  1.0 3.0
   68    50    52    53  -0.11600  1.0 1.0
   68    50    52    53  -0.09450 -1.0 2.0
   68    50    52    53   0.21250  1.0 3.0
   68    64    71    72  -0.11600  1.0 1.0
   68    64    71    72  -0.09450 -1.0 2.0
   68    64    71    72   0.21250  1.0 3.0
   71    64    68    50   0.86500  1.0 1.0
   71    64    68    50  -0.17500 -1.0 2.0
   71    64    68    50   0.20800  1.0 3.0
   71    64    68    69   0.23400  1.0 3.0
   71    64    68    70   0.23400  1.0 3.0
   56    51    54    55   7.00000 -1.0 2.0
   56    51    54    58   7.00000 -1.0 2.0
   56    61    66    67   0.30150 -1.0 2.0
   56    61    66    73   0.65300  1.0 1.0
   56    61    66    73  -0.03850 -1.0 2.0
   56    61    66    73   0.33900  1.0 3.0
   57    56    61    62   0.00000  1.0 1.0
   57    56    61    63   0.00000  1.0 1.0
   57    56    61    66   0.30150 -1.0 2.0
   61    66    73    74   0.00000  1.0 1.0
   61    66    73    75   0.00000  1.0 1.0
   61    66    73    76   0.00000  1.0 1.0
   62    61    66    67   0.00000  1.0 1.0
   62    61    66    73   0.00000  1.0 1.0
   63    61    66    67   0.00000  1.0 1.0
   63    61    66    73   0.00000  1.0 1.0
   67    66    73    74   0.00000  1.0 1.0
   67    66    73    75   0.00000  1.0 1.0
   67    66    73    76   0.00000  1.0 1.0
   52    50    51    54   0.67800  1.0 1.0
   52    50    51    54   0.47050 -1.0 2.0
   52    50    51    54  -0.62500  1.0 3.0
   52    50    51    56   0.09700  1.0 1.0
   52    50    51    56   0.15600 -1.0 2.0
   52    50    51    56  -0.50800  1.0 3.0
   52    50    68    64   0.86500  1.0 1.0
   52    50    68    64  -0.17500 -1.0 2.0
   52    50    68    64   0.20800  1.0 3.0
   52    50    68    69   0.23400  1.0 3.0
   52    50    68    70   0.23400  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   29    34    33    38  15.00000 -1.0 2.0
   40    39    38    33  15.00000 -1.0 2.0
   38    42    40    41  10.50000 -1.0 2.0
   42    47    45    46  10.50000 -1.0 2.0
   50    56    51    54   1.10000 -1.0 2.0
   58    55    54    51   1.10000 -1.0 2.0
   51    61    56    57  10.50000 -1.0 2.0
   61    73    66    67  10.50000 -1.0 2.0
END
